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5-EPI-CINNAMOYLCANADENSENE
SpectraBase Compound ID 1j6mo6Qjw0f
InChI InChI=1S/C39H48O13/c1-21-31(47-23(3)41)18-30-34(49-25(5)43)17-29(20-40)33(52-35(46)16-15-28-13-11-10-12-14-28)19-32(48-24(4)42)22(2)37(50-26(6)44)38(51-27(7)45)36(21)39(30,8)9/h10-17,30-34,38,40H,18-20H2,1-9H3/b16-15+,29-17+,37-22-
InChIKey FKDZVYSKSQDUKG-RXGJATLNSA-N
Mol Weight 724.8 g/mol
Molecular Formula C39H48O13
Exact Mass 724.309492 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J2rIvK8TkpK
Name 5-EPI-CINNAMOYLCANADENSENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H48O13
InChI InChI=1S/C39H48O13/c1-21-31(47-23(3)41)18-30-34(49-25(5)43)17-29(20-40)33(52-35(46)16-15-28-13-11-10-12-14-28)19-32(48-24(4)42)22(2)37(50-26(6)44)38(51-27(7)45)36(21)39(30,8)9/h10-17,30-34,38,40H,18-20H2,1-9H3/b16-15+,29-17+,37-22-
InChIKey FKDZVYSKSQDUKG-RXGJATLNSA-N
Literature Reference Author J.ZHANG,F.SAURIOL,O.MAMER,L.O.ZAMIR
Literature Reference Citation J.NAT.PROD.,63,929(2000)
Literature Reference DOI 10.1021/np000053u
Molecular Weight 724.802 g/mol
Solvent CDCl3
Source File Reference UWRU8542